In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | Yes |
Popular Name: 2-[(2-oxo-2-piperazin-1-yl-ethyl)amino]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile 2-[(2-oxo-2-piperazin-1-yl-ethyl…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.13 | 4.93 | -53.22 | 3 | 6 | 1 | 86 | 286.359 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.13 | 3.64 | -11.47 | 2 | 6 | 0 | 81 | 285.351 | 3 | ↓ |